N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide

C14H22N2OS — CID 7196991

IUPACN-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide
SMILESCc1nc(C)c(CCNC(=O)C2CCCCC2)s1
InChIInChI=1S/C14H22N2OS/c1-10-13(18-11(2)16-10)8-9-15-14(17)12-6-4-3-5-7-12/h12H,3-9H2,1-2H3,(H,15,17)
InChIKeyNCGSACYAFZCLLZ-UHFFFAOYSA-N
MW266.41 g/mol
LogP3.00
Rot. Bonds4

About N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide

N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide (PubChem CID 7196991) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide
PubChem CID7196991
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC NameN-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide
SMILESCc1nc(C)c(CCNC(=O)C2CCCCC2)s1
InChIInChI=1S/C14H22N2OS/c1-10-13(18-11(2)16-10)8-9-15-14(17)12-6-4-3-5-7-12/h12H,3-9H2,1-2H3,(H,15,17)
InChIKeyNCGSACYAFZCLLZ-UHFFFAOYSA-N
XLogP3.00
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide?
The IUPAC name of N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide (CID 7196991) is N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide?
The canonical SMILES for N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide is Cc1nc(C)c(CCNC(=O)C2CCCCC2)s1.
What is the InChIKey of N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide?
The InChIKey is NCGSACYAFZCLLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-10-13(18-11(2)16-10)8-9-15-14(17)12-6-4-3-5-7-12/h12H,3-9H2,1-2H3,(H,15,17).
What are the key properties of N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide?
N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide has a molecular weight of 266.41 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide is sourced from PubChem (CID 7196991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).